1-(1-Isobutoxy-3-{[1-(1-Propyn-1-Yl)Cyclohexyl]Oxy}-2-Propanyl)Pyrrolidine

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Formula C20H35NO2
IUPAC Name 1-[(1s)-1-(isobutoxymethyl)-2-(1-prop-1-ynylcyclohexoxy)ethyl]pyrrolidine
Molecular Mass 321.497 g·mol−1
Heat of Formation -340.0 ± 16.7 kJ·mol−1
Dipole Moment 2.04 ± 1.08 D
Volume 446.89 Å 3
Surface Area 352.72 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 1.31 ± eV
Point Group Symmetry C1
InChIKey FITWYAUFKJXWPL-IBGZPJMESA-N
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